SCHEMBL8397154

SCHEMBL8397154

CCCCN(CCCC)C(C)CCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.47
GABRD O14764 2/20 0.47
GABRA1 P14867 2/20 0.47
GABRB1 P18505 2/20 0.47
GABRG2 P18507 2/20 0.47
GABRB3 P28472 2/20 0.47
GABRA5 P31644 2/20 0.47
GABRA3 P34903 2/20 0.47
GABRA2 P47869 2/20 0.47
GABRB2 P47870 2/20 0.47
GABRA4 P48169 2/20 0.47
GABRE P78334 2/20 0.47
GABRA6 Q16445 2/20 0.47
GABRG1 Q8N1C3 2/20 0.47
GABRG3 Q99928 2/20 0.47
GABRQ Q9UN88 2/20 0.47
AKR1B1 P15121 1/20 0.45
GPR84 Q9NQS5 7/20 0.43
PPARG P37231 7/20 0.43
PPARD Q03181 7/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5084376 0.82 MMP1 (0.33) AKR1B1GPR84PPARDFFAR1FFAR4
SCHEMBL8395555 0.81 MMP1 (0.47) ALDH1A1HSD17B10
SCHEMBL5432078 0.80 KDM4C (0.41) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL7141671 0.79 GABRP (0.54) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL11342740 0.78 AKR1B1 (0.46) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL24114955 0.77 OPRM1 (0.35) TSHRALDH1A1
SCHEMBL4939550 0.76 KDM5A (0.44) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL5283650 0.75 AKR1B1 (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL3104058 0.75 ALDH1A1 (0.38) TSHRALDH1A1MEN1KMT2AHSD17B10
Hydrochloric Acid SCHEMBL14889209 0.74 DNM1 (0.33)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0748310-B1 DIESTERS OF CARBONIC ACID ENDOWED WITH ANTIVIRAL AND ANTI-INFLAMMATORY ACTIVITY ITALFARMACO SPA (IT) 1999-06-02 EP disclosed
US-5827881-A ADMINISTERING FOR TREATMENT OF VIRAL DISEASES OR AS ANTIINFLAMMATORY AGENTS ITALFARMACO S.P.A. (IT) 1998-10-27 US disclosed
CN-1142222-A Diesters of carbonic acid endowed with antiviral and anti-inflammatory activity ITALFARMACO SPA (IT) 1997-02-05 CN disclosed
EP-0748310-A1 DIESTERS OF CARBONIC ACID ENDOWED WITH ANTIVIRAL AND ANTI-INFLAMMATORY ACTIVITY ITALFARMACO S.p.A. (IT) 1996-12-18 EP disclosed
WO-1995023128-A1 DIESTERS OF CARBONIC ACID ENDOWED WITH ANTIVIRAL AND ANTI-INFLAMMATORY ACTIVITY ITALFARMACO S.P.A. (IT) 1995-08-31 WO disclosed